SCHEMBL4134952

SCHEMBL4134952

CCC(=O)C1=C(c2ccc3ccccc3c2)CC2CC(O)C1N2C

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 13/20 0.74
SLC6A4 P31645 11/20 0.74
SLC6A2 P23975 1/20 0.39
ACHE P22303 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4153966 1.00 SLC6A3 (0.74) SLC6A3SLC6A4SLC6A2ACHE
SCHEMBL4134950 1.00 SLC6A3 (0.74) SLC6A3SLC6A4SLC6A2ACHE
SCHEMBL5405043 0.85 SLC6A3 (1.00) SLC6A3SLC6A4SLC6A2
SCHEMBL5405048 0.85 SLC6A3 (1.00) SLC6A3SLC6A4SLC6A2
SCHEMBL4140982 0.83 SLC6A3 (0.74) SLC6A3SLC6A4
SCHEMBL4140981 0.83 SLC6A3 (0.74) SLC6A3SLC6A4
SCHEMBL4153559 0.83 SLC6A3 (0.74) SLC6A3SLC6A4
SCHEMBL4137753 0.81 SLC6A3 (0.72) SLC6A3SLC6A4
SCHEMBL4137751 0.81 SLC6A3 (0.72) SLC6A3SLC6A4
SCHEMBL4144578 0.81 SLC6A3 (0.56) SLC6A3SLC6A4SLC6A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090208415-A1 Tropane compounds PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2009-08-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090208415-A1 Tropane compounds TPM3, TPM4, ADRA2C SLC6A3 196/4885SLC6A4 217/4885SLC6A2 93/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.